2-(4,6-dinaphthalen-2-ylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-(4,6-diphenylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]pyrazolo[1,5-a]quinoline;2-[4-(5-phenyl-2-pyridinyl)-6-(4-pyridin-2-ylphenyl)-2-pyridinyl]pyrazolo[1,5-a]quinoline

C133H87N17 — CID 159044227

IUPAC2-(4,6-dinaphthalen-2-ylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-(4,6-diphenylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]pyrazolo[1,5-a]quinoline;2-[4-(5-phenyl-2-pyridinyl)-6-(4-pyridin-2-ylphenyl)-2-pyridinyl]pyrazolo[1,5-a]quinoline
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-c3cc4ccc5ccccc5n4n3)n2)cc1.c1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccccn5)cc4)nc(-c4cc5ccc6ccccc6n5n4)c3)nc2)cc1.c1ccc(-c2ccc(-c3cc(-c4ccccc4)nc(-c4cc5ccc6ccccc6n5n4)n3)cc2)cc1.c1ccc2cc(-c3cc(-c4ccc5ccccc5c4)nc(-c4cc5ccc6ccccc6n5n4)n3)ccc2c1
InChIInChI=1S/C38H25N5.C35H22N4.C33H22N4.C27H18N4/c1-2-8-26(9-3-1)30-18-20-34(40-25-30)31-22-35(28-15-13-27(14-16-28)33-11-6-7-21-39-33)41-36(23-31)37-24-32-19-17-29-10-4-5-12-38(29)43(32)42-37;1-3-10-26-19-28(15-13-23(26)7-1)31-22-32(29-16-14-24-8-2-4-11-27(24)20-29)37-35(36-31)33-21-30-18-17-25-9-5-6-12-34(25)39(30)38-33;1-3-9-23(10-4-1)24-15-17-26(18-16-24)30-22-29(25-11-5-2-6-12-25)34-33(35-30)31-21-28-20-19-27-13-7-8-14-32(27)37(28)36-31;1-3-9-19(10-4-1)23-18-24(20-11-5-2-6-12-20)29-27(28-23)25-17-22-16-15-21-13-7-8-14-26(21)31(22)30-25/h1-25H;1-22H;1-22H;1-18H
InChIKeyJWLJHHWTAOPHRV-UHFFFAOYSA-N
MW1923.28 g/mol
LogP31.82
Rot. Bonds15

About 2-(4,6-dinaphthalen-2-ylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-(4,6-diphenylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]pyrazolo[1,5-a]quinoline;2-[4-(5-phenyl-2-pyridinyl)-6-(4-pyridin-2-ylphenyl)-2-pyridinyl]pyrazolo[1,5-a]quinoline

2-(4,6-dinaphthalen-2-ylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-(4,6-diphenylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]pyrazolo[1,5-a]quinoline;2-[4-(5-phenyl-2-pyridinyl)-6-(4-pyridin-2-ylphenyl)-2-pyridinyl]pyrazolo[1,5-a]quinoline (PubChem CID 159044227) has the molecular formula C133H87N17 and a molecular weight of 1923.28 g/mol. Its IUPAC name is 2-(4,6-dinaphthalen-2-ylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-(4,6-diphenylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]pyrazolo[1,5-a]quinoline;2-[4-(5-phenyl-2-pyridinyl)-6-(4-pyridin-2-ylphenyl)-2-pyridinyl]pyrazolo[1,5-a]quinoline.

Molecular Properties

Compound Name2-(4,6-dinaphthalen-2-ylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-(4,6-diphenylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]pyrazolo[1,5-a]quinoline;2-[4-(5-phenyl-2-pyridinyl)-6-(4-pyridin-2-ylphenyl)-2-pyridinyl]pyrazolo[1,5-a]quinoline
PubChem CID159044227
Molecular FormulaC133H87N17
Molecular Weight1923.28 g/mol
Exact Mass1921.73
IUPAC Name2-(4,6-dinaphthalen-2-ylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-(4,6-diphenylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]pyrazolo[1,5-a]quinoline;2-[4-(5-phenyl-2-pyridinyl)-6-(4-pyridin-2-ylphenyl)-2-pyridinyl]pyrazolo[1,5-a]quinoline
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-c3cc4ccc5ccccc5n4n3)n2)cc1.c1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccccn5)cc4)nc(-c4cc5ccc6ccccc6n5n4)c3)nc2)cc1.c1ccc(-c2ccc(-c3cc(-c4ccccc4)nc(-c4cc5ccc6ccccc6n5n4)n3)cc2)cc1.c1ccc2cc(-c3cc(-c4ccc5ccccc5c4)nc(-c4cc5ccc6ccccc6n5n4)n3)ccc2c1
InChIInChI=1S/C38H25N5.C35H22N4.C33H22N4.C27H18N4/c1-2-8-26(9-3-1)30-18-20-34(40-25-30)31-22-35(28-15-13-27(14-16-28)33-11-6-7-21-39-33)41-36(23-31)37-24-32-19-17-29-10-4-5-12-38(29)43(32)42-37;1-3-10-26-19-28(15-13-23(26)7-1)31-22-32(29-16-14-24-8-2-4-11-27(24)20-29)37-35(36-31)33-21-30-18-17-25-9-5-6-12-34(25)39(30)38-33;1-3-9-23(10-4-1)24-15-17-26(18-16-24)30-22-29(25-11-5-2-6-12-25)34-33(35-30)31-21-28-20-19-27-13-7-8-14-32(27)37(28)36-31;1-3-9-19(10-4-1)23-18-24(20-11-5-2-6-12-20)29-27(28-23)25-17-22-16-15-21-13-7-8-14-26(21)31(22)30-25/h1-25H;1-22H;1-22H;1-18H
InChIKeyJWLJHHWTAOPHRV-UHFFFAOYSA-N
XLogP31.82
TPSA185.21 Ų
H-Bond Donors
H-Bond Acceptors17
Rotatable Bonds15
Heavy Atoms150
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001923.28
LogP ≤ 531.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1017

Analyze 2-(4,6-dinaphthalen-2-ylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-(4,6-diphenylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]pyrazolo[1,5-a]quinoline;2-[4-(5-phenyl-2-pyridinyl)-6-(4-pyridin-2-ylphenyl)-2-pyridinyl]pyrazolo[1,5-a]quinoline with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-(4,6-dinaphthalen-2-ylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-(4,6-diphenylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]pyrazolo[1,5-a]quinoline;2-[4-(5-phenyl-2-pyridinyl)-6-(4-pyridin-2-ylphenyl)-2-pyridinyl]pyrazolo[1,5-a]quinoline?
The IUPAC name of 2-(4,6-dinaphthalen-2-ylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-(4,6-diphenylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]pyrazolo[1,5-a]quinoline;2-[4-(5-phenyl-2-pyridinyl)-6-(4-pyridin-2-ylphenyl)-2-pyridinyl]pyrazolo[1,5-a]quinoline (CID 159044227) is 2-(4,6-dinaphthalen-2-ylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-(4,6-diphenylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]pyrazolo[1,5-a]quinoline;2-[4-(5-phenyl-2-pyridinyl)-6-(4-pyridin-2-ylphenyl)-2-pyridinyl]pyrazolo[1,5-a]quinoline.
What is the SMILES notation for 2-(4,6-dinaphthalen-2-ylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-(4,6-diphenylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]pyrazolo[1,5-a]quinoline;2-[4-(5-phenyl-2-pyridinyl)-6-(4-pyridin-2-ylphenyl)-2-pyridinyl]pyrazolo[1,5-a]quinoline?
The canonical SMILES for 2-(4,6-dinaphthalen-2-ylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-(4,6-diphenylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]pyrazolo[1,5-a]quinoline;2-[4-(5-phenyl-2-pyridinyl)-6-(4-pyridin-2-ylphenyl)-2-pyridinyl]pyrazolo[1,5-a]quinoline is c1ccc(-c2cc(-c3ccccc3)nc(-c3cc4ccc5ccccc5n4n3)n2)cc1.c1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccccn5)cc4)nc(-c4cc5ccc6ccccc6n5n4)c3)nc2)cc1.c1ccc(-c2ccc(-c3cc(-c4ccccc4)nc(-c4cc5ccc6ccccc6n5n4)n3)cc2)cc1.c1ccc2cc(-c3cc(-c4ccc5ccccc5c4)nc(-c4cc5ccc6ccccc6n5n4)n3)ccc2c1.
What is the InChIKey of 2-(4,6-dinaphthalen-2-ylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-(4,6-diphenylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]pyrazolo[1,5-a]quinoline;2-[4-(5-phenyl-2-pyridinyl)-6-(4-pyridin-2-ylphenyl)-2-pyridinyl]pyrazolo[1,5-a]quinoline?
The InChIKey is JWLJHHWTAOPHRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H25N5.C35H22N4.C33H22N4.C27H18N4/c1-2-8-26(9-3-1)30-18-20-34(40-25-30)31-22-35(28-15-13-27(14-16-28)33-11-6-7-21-39-33)41-36(23-31)37-24-32-19-17-29-10-4-5-12-38(29)43(32)42-37;1-3-10-26-19-28(15-13-23(26)7-1)31-22-32(29-16-14-24-8-2-4-11-27(24)20-29)37-35(36-31)33-21-30-18-17-25-9-5-6-12-34(25)39(30)38-33;1-3-9-23(10-4-1)24-15-17-26(18-16-24)30-22-29(25-11-5-2-6-12-25)34-33(35-30)31-21-28-20-19-27-13-7-8-14-32(27)37(28)36-31;1-3-9-19(10-4-1)23-18-24(20-11-5-2-6-12-20)29-27(28-23)25-17-22-16-15-21-13-7-8-14-26(21)31(22)30-25/h1-25H;1-22H;1-22H;1-18H.
What are the key properties of 2-(4,6-dinaphthalen-2-ylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-(4,6-diphenylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]pyrazolo[1,5-a]quinoline;2-[4-(5-phenyl-2-pyridinyl)-6-(4-pyridin-2-ylphenyl)-2-pyridinyl]pyrazolo[1,5-a]quinoline?
2-(4,6-dinaphthalen-2-ylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-(4,6-diphenylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]pyrazolo[1,5-a]quinoline;2-[4-(5-phenyl-2-pyridinyl)-6-(4-pyridin-2-ylphenyl)-2-pyridinyl]pyrazolo[1,5-a]quinoline has a molecular weight of 1923.28 g/mol, XLogP of 31.82, 15 rotatable bonds, 0 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,6-dinaphthalen-2-ylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-(4,6-diphenylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]pyrazolo[1,5-a]quinoline;2-[4-(5-phenyl-2-pyridinyl)-6-(4-pyridin-2-ylphenyl)-2-pyridinyl]pyrazolo[1,5-a]quinoline is sourced from PubChem (CID 159044227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).